3-[[6-[2,2-dimethylpropyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]-N,4-dimethyl-benzamide

Systemtic Name: 3-[[6-[2,2-dimethylpropyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]-N,4-dimethyl-benzamide Openeye Name: 3-[[6-[2,2-dimethylpropyl(methyl)amino]-5-nitro-pyrimidin-4-yl]amino]-N,4-dimethyl-benzamide CAS Name: 3-[[6-[2,2-dimethylpropyl(methyl)amino]-5-nitro-4-pyrimidinyl]amino]-N,4-dimethylbenzamide IUPAC Name: 3-[[6-[2,2-dimethylpropyl(methyl)amino]-5-nitropyrimidin-4-yl]amino]-N,4-dimethylbenzamide Traditional Name: N,4-dimethyl-3-[[6-[methyl(neopentyl)amino]-5-nitro-pyrimidin-4-yl]amino]benzamide Formula: C19H26N6O3 MolecularWeight: 386.44814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC)NC2=C(C(=NC=N2)N(C)CC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC)NC2=C(C(=NC=N2)N(C)CC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C19H26N6O3/c1-12-7-8-13(18(26)20-5)9-14(12)23-16-15(25(27)28)17(22-11-21-16)24(6)10-19(2,3)4/h7-9,11H,10H2,1-6H3,(H,20,26)(H,21,22,23)